(2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate

Systemtic Name: (2-morpholin-4-yl-2-oxidanylidene-1-phenyl-ethyl) 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate Openeye Name: (2-morpholino-2-oxo-1-phenyl-ethyl) 4-methoxy-3-pyrrolidin-1-ylsulfonyl-benzoate CAS Name: 4-methoxy-3-(1-pyrrolidinylsulfonyl)benzoic acid [2-(4-morpholinyl)-2-oxo-1-phenylethyl] ester IUPAC Name: (2-morpholin-4-yl-2-oxo-1-phenylethyl) 4-methoxy-3-pyrrolidin-1-ylsulfonylbenzoate Traditional Name: 4-methoxy-3-pyrrolidinosulfonyl-benzoic acid (2-keto-2-morpholino-1-phenyl-ethyl) ester Formula: C24H28N2O7S MolecularWeight: 488.55332

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCOCC3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OC(C2=CC=CC=C2)C(=O)N3CCOCC3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C24H28N2O7S/c1-31-20-10-9-19(17-21(20)34(29,30)26-11-5-6-12-26)24(28)33-22(18-7-3-2-4-8-18)23(27)25-13-15-32-16-14-25/h2-4,7-10,17,22H,5-6,11-16H2,1H3